2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-pyridin-1-ium-1-yl-ethanone

Systemtic Name: 2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-pyridin-1-ium-1-yl-ethanone Openeye Name: 2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-pyridin-1-ium-1-yl-ethanone CAS Name: 2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-(1-pyridin-1-iumyl)ethanone IUPAC Name: 2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-pyridin-1-ium-1-ylethanone Traditional Name: 2-[4-(bromomethyl)-1,3-dithiolan-2-ylidene]-1-phenyl-2-pyridin-1-ium-1-yl-ethanone Formula: C17H15BrNOS2+ MolecularWeight: 393.3411

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=C(C(=O)C2=CC=CC=C2)[N+]3=CC=CC=C3)S1)CBr

Isomeric SMILES

C1C(SC(=C(C(=O)C2=CC=CC=C2)[N+]3=CC=CC=C3)S1)CBr

InChI

InChI=1S/C17H15BrNOS2/c18-11-14-12-21-17(22-14)15(19-9-5-2-6-10-19)16(20)13-7-3-1-4-8-13/h1-10,14H,11-12H2/q+1